Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | HTR7 | P34969 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.39 |
| ▸ | HCN1 | O60741 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14939017 | 0.90 | HTR7 (0.48) | ALDH1A1KDM4EMAPTHTTSIGMAR1 | |
| SCHEMBL14939089 | 0.88 | KMT2A (0.42) | ALDH1A1KDM4ELMNAMAPTHTT | |
| SCHEMBL14939091 | 0.88 | KMT2A (0.42) | ALDH1A1KDM4ELMNAMAPTHTT | |
| SCHEMBL14939559 | 0.88 | KMT2A (0.42) | ALDH1A1KDM4ELMNAMAPTHTT | |
| SCHEMBL14939823 | 0.87 | HTR6 (0.41) | ALDH1A1KDM4ELMNAMAPTHTT | |
| SCHEMBL14939907 | 0.87 | SIGMAR1 (0.55) | ALDH1A1KDM4ELMNAMAPTSIGMAR1 | |
| SCHEMBL14940301 | 0.87 | SIGMAR1 (0.55) | ALDH1A1HTTSIGMAR1DRD2HTR2A | |
| SCHEMBL14939941 | 0.87 | KMT2A (0.47) | ALDH1A1KDM4ELMNAHTR7DRD2 | |
| SCHEMBL14939591 | 0.86 | SIGMAR1 (0.50) | ALDH1A1KDM4ESIGMAR1DRD2HTR2A | |
| SCHEMBL14939079 | 0.86 | ALDH1A1 (0.49) | ALDH1A1KDM4ELMNAMAPTHTT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | claimed |
| WO-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | disclosed |